5-[(2-chloranyl-4-nitro-phenoxy)methyl]-3-(2-methylpropyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(2-chloranyl-4-nitro-phenoxy)methyl]-3-(2-methylpropyl)-1,2,4-oxadiazole Openeye Name: 5-[(2-chloro-4-nitro-phenoxy)methyl]-3-isobutyl-1,2,4-oxadiazole CAS Name: 5-[(2-chloro-4-nitrophenoxy)methyl]-3-(2-methylpropyl)-1,2,4-oxadiazole IUPAC Name: 5-[(2-chloro-4-nitrophenoxy)methyl]-3-(2-methylpropyl)-1,2,4-oxadiazole Traditional Name: 5-[(2-chloro-4-nitro-phenoxy)methyl]-3-isobutyl-1,2,4-oxadiazole Formula: C13H14ClN3O4 MolecularWeight: 311.72096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H14ClN3O4/c1-8(2)5-12-15-13(21-16-12)7-20-11-4-3-9(17(18)19)6-10(11)14/h3-4,6,8H,5,7H2,1-2H3